N-[4-(4-carbazol-9-ylphenyl)phenyl]-9,9-diphenyl-N-(4-phenylphenyl)fluoren-2-amine;2-[10-(dicyanomethylidene)-2,8-bis(trifluoromethoxy)indeno[2,1-b]fluoren-12-ylidene]propanedinitrile;3-(9,10-dinaphthalen-2-ylanthracen-2-yl)fluoranthene;2,9,10-trinaphthalen-2-ylanthracene

C183H108F6N6O2 — CID 157179774

IUPACN-[4-(4-carbazol-9-ylphenyl)phenyl]-9,9-diphenyl-N-(4-phenylphenyl)fluoren-2-amine;2-[10-(dicyanomethylidene)-2,8-bis(trifluoromethoxy)indeno[2,1-b]fluoren-12-ylidene]propanedinitrile;3-(9,10-dinaphthalen-2-ylanthracen-2-yl)fluoranthene;2,9,10-trinaphthalen-2-ylanthracene
SMILESN#CC(C#N)=C1c2cc(OC(F)(F)F)ccc2-c2cc3c(cc21)C(=C(C#N)C#N)c1cc(OC(F)(F)F)ccc1-3.c1ccc(-c2ccc(N(c3ccc(-c4ccc(-n5c6ccccc6c6ccccc65)cc4)cc3)c3ccc4c(c3)C(c3ccccc3)(c3ccccc3)c3ccccc3-4)cc2)cc1.c1ccc2c(c1)-c1cccc3c(-c4ccc5c(-c6ccc7ccccc7c6)c6ccccc6c(-c6ccc7ccccc7c6)c5c4)ccc-2c13.c1ccc2cc(-c3ccc4c(-c5ccc6ccccc6c5)c5ccccc5c(-c5ccc6ccccc6c5)c4c3)ccc2c1
InChIInChI=1S/C61H42N2.C50H30.C44H28.C28H8F6N4O2/c1-4-16-43(17-5-1)44-28-34-49(35-29-44)62(50-36-30-45(31-37-50)46-32-38-51(39-33-46)63-59-26-14-11-23-55(59)56-24-12-15-27-60(56)63)52-40-41-54-53-22-10-13-25-57(53)61(58(54)42-52,47-18-6-2-7-19-47)48-20-8-3-9-21-48;1-3-12-33-28-36(22-20-31(33)10-1)48-43-16-7-8-17-44(43)49(37-23-21-32-11-2-4-13-34(32)29-37)47-30-35(24-25-46(47)48)38-26-27-45-40-15-6-5-14-39(40)42-19-9-18-41(38)50(42)45;1-4-12-32-25-35(20-17-29(32)9-1)36-23-24-41-42(28-36)44(38-22-19-31-11-3-6-14-34(31)27-38)40-16-8-7-15-39(40)43(41)37-21-18-30-10-2-5-13-33(30)26-37;29-27(30,31)39-15-1-3-17-19-7-20-18-4-2-16(40-28(32,33)34)6-22(18)26(14(11-37)12-38)24(20)8-23(19)25(21(17)5-15)13(9-35)10-36/h1-42H;1-30H;1-28H;1-8H
InChIKeyAOKYIZAGZIDZTO-UHFFFAOYSA-N
MW2536.90 g/mol
LogP49.65
Rot. Bonds16

About N-[4-(4-carbazol-9-ylphenyl)phenyl]-9,9-diphenyl-N-(4-phenylphenyl)fluoren-2-amine;2-[10-(dicyanomethylidene)-2,8-bis(trifluoromethoxy)indeno[2,1-b]fluoren-12-ylidene]propanedinitrile;3-(9,10-dinaphthalen-2-ylanthracen-2-yl)fluoranthene;2,9,10-trinaphthalen-2-ylanthracene

N-[4-(4-carbazol-9-ylphenyl)phenyl]-9,9-diphenyl-N-(4-phenylphenyl)fluoren-2-amine;2-[10-(dicyanomethylidene)-2,8-bis(trifluoromethoxy)indeno[2,1-b]fluoren-12-ylidene]propanedinitrile;3-(9,10-dinaphthalen-2-ylanthracen-2-yl)fluoranthene;2,9,10-trinaphthalen-2-ylanthracene (PubChem CID 157179774) has the molecular formula C183H108F6N6O2 and a molecular weight of 2536.90 g/mol. Its IUPAC name is N-[4-(4-carbazol-9-ylphenyl)phenyl]-9,9-diphenyl-N-(4-phenylphenyl)fluoren-2-amine;2-[10-(dicyanomethylidene)-2,8-bis(trifluoromethoxy)indeno[2,1-b]fluoren-12-ylidene]propanedinitrile;3-(9,10-dinaphthalen-2-ylanthracen-2-yl)fluoranthene;2,9,10-trinaphthalen-2-ylanthracene.

Molecular Properties

Compound NameN-[4-(4-carbazol-9-ylphenyl)phenyl]-9,9-diphenyl-N-(4-phenylphenyl)fluoren-2-amine;2-[10-(dicyanomethylidene)-2,8-bis(trifluoromethoxy)indeno[2,1-b]fluoren-12-ylidene]propanedinitrile;3-(9,10-dinaphthalen-2-ylanthracen-2-yl)fluoranthene;2,9,10-trinaphthalen-2-ylanthracene
PubChem CID157179774
Molecular FormulaC183H108F6N6O2
Molecular Weight2536.90 g/mol
Exact Mass2534.84
IUPAC NameN-[4-(4-carbazol-9-ylphenyl)phenyl]-9,9-diphenyl-N-(4-phenylphenyl)fluoren-2-amine;2-[10-(dicyanomethylidene)-2,8-bis(trifluoromethoxy)indeno[2,1-b]fluoren-12-ylidene]propanedinitrile;3-(9,10-dinaphthalen-2-ylanthracen-2-yl)fluoranthene;2,9,10-trinaphthalen-2-ylanthracene
SMILESN#CC(C#N)=C1c2cc(OC(F)(F)F)ccc2-c2cc3c(cc21)C(=C(C#N)C#N)c1cc(OC(F)(F)F)ccc1-3.c1ccc(-c2ccc(N(c3ccc(-c4ccc(-n5c6ccccc6c6ccccc65)cc4)cc3)c3ccc4c(c3)C(c3ccccc3)(c3ccccc3)c3ccccc3-4)cc2)cc1.c1ccc2c(c1)-c1cccc3c(-c4ccc5c(-c6ccc7ccccc7c6)c6ccccc6c(-c6ccc7ccccc7c6)c5c4)ccc-2c13.c1ccc2cc(-c3ccc4c(-c5ccc6ccccc6c5)c5ccccc5c(-c5ccc6ccccc6c5)c4c3)ccc2c1
InChIInChI=1S/C61H42N2.C50H30.C44H28.C28H8F6N4O2/c1-4-16-43(17-5-1)44-28-34-49(35-29-44)62(50-36-30-45(31-37-50)46-32-38-51(39-33-46)63-59-26-14-11-23-55(59)56-24-12-15-27-60(56)63)52-40-41-54-53-22-10-13-25-57(53)61(58(54)42-52,47-18-6-2-7-19-47)48-20-8-3-9-21-48;1-3-12-33-28-36(22-20-31(33)10-1)48-43-16-7-8-17-44(43)49(37-23-21-32-11-2-4-13-34(32)29-37)47-30-35(24-25-46(47)48)38-26-27-45-40-15-6-5-14-39(40)42-19-9-18-41(38)50(42)45;1-4-12-32-25-35(20-17-29(32)9-1)36-23-24-41-42(28-36)44(38-22-19-31-11-3-6-14-34(31)27-38)40-16-8-7-15-39(40)43(41)37-21-18-30-10-2-5-13-33(30)26-37;29-27(30,31)39-15-1-3-17-19-7-20-18-4-2-16(40-28(32,33)34)6-22(18)26(14(11-37)12-38)24(20)8-23(19)25(21(17)5-15)13(9-35)10-36/h1-42H;1-30H;1-28H;1-8H
InChIKeyAOKYIZAGZIDZTO-UHFFFAOYSA-N
XLogP49.65
TPSA121.79 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds16
Heavy Atoms197
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002536.90
LogP ≤ 549.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'ene_cyano_A(19)', 'substructure': 'N/A'}, {'alert_name': 'conjugated_nitrile_group', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}

Analyze N-[4-(4-carbazol-9-ylphenyl)phenyl]-9,9-diphenyl-N-(4-phenylphenyl)fluoren-2-amine;2-[10-(dicyanomethylidene)-2,8-bis(trifluoromethoxy)indeno[2,1-b]fluoren-12-ylidene]propanedinitrile;3-(9,10-dinaphthalen-2-ylanthracen-2-yl)fluoranthene;2,9,10-trinaphthalen-2-ylanthracene with MolForge

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Related Compounds

9-(4-Tert-butylphenyl)-3,6-bis[9-(4-methoxyphenyl)fluoren-9-yl]carbazole
CID 53401213
9-Phenyl-3,6-bis[4-(1,2,2-trifluoroethenoxy)phenyl]carbazole
CID 59582224
N-[4-[6-[6-[4-[N-(9,9-dimethylfluoren-2-yl)-4-[4-(1,2,2-trifluoroethenoxy)phenyl]anilino]phenyl]-9-phenylcarbazol-3-yl]-9-phenylcarbazol-3-yl]phenyl]-9,9-dimethyl-N-[4-[4-(1,2,2-trifluoroethenoxy)phenyl]phenyl]fluoren-2-amine
CID 90164118
6-(9,9-Dimethylxanthen-3-yl)-9-[4-(trifluoromethyl)phenyl]carbazole-3-carbonitrile
CID 121297511
5-(9,9-dimethylfluoren-2-yl)-N-(4-fluorophenyl)-N-(8-oxatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2,4,6,9,11,13,15-octaen-14-yl)benzo[b]carbazol-2-amine
CID 121357331
N-(9,9-diphenylfluoren-2-yl)-N-[4-[9-(4-fluorophenyl)carbazol-2-yl]phenyl]-8-oxatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2(7),3,5,9,11,13(17),14-octaen-5-amine
CID 121357412
7,7-Dipropyl-5-pyridin-4-yl-2-[3-[3-[3-(1,2,2-trifluoroethenoxy)phenyl]carbazol-9-yl]phenyl]-9-[3-[3-[3-(1,2,2-trifluoroethenoxy)phenyl]-1,2-dihydrocarbazol-9-yl]phenyl]indeno[2,1-b]carbazole
CID 123546009
N-[3-[10-[3-[N-naphthalen-1-yl-4-(1,2,2-trifluoroethenoxy)anilino]phenyl]-13,13-diphenyl-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8(20),9,11,14,16,18-nonaen-5-yl]phenyl]-N-[4-(1,2,2-trifluoroethenoxy)phenyl]naphthalen-1-amine
CID 126624344
7,7-Dipropyl-5-pyridin-4-yl-2,9-bis[3-[3-[3-(1,2,2-trifluoroethenoxy)phenyl]carbazol-9-yl]phenyl]indeno[2,1-b]carbazole
CID 126624356
2-[5-[3,6-Bis(trifluoromethyl)carbazol-9-yl]-4-(2-cyanophenyl)-2-(2,7-dimethoxycarbazol-9-yl)phenyl]benzonitrile
CID 132111893
N-[4-(3-carbazol-9-ylphenyl)phenyl]-4-phenyl-N-[4-[4-[4-(trifluoromethoxy)phenyl]phenyl]phenyl]aniline
CID 138467444
4-(4-carbazol-9-ylphenyl)-N-[4-(3-phenylphenyl)phenyl]-N-[4-[4-(trifluoromethoxy)phenyl]phenyl]aniline
CID 138467452

Frequently Asked Questions

What is the IUPAC name of N-[4-(4-carbazol-9-ylphenyl)phenyl]-9,9-diphenyl-N-(4-phenylphenyl)fluoren-2-amine;2-[10-(dicyanomethylidene)-2,8-bis(trifluoromethoxy)indeno[2,1-b]fluoren-12-ylidene]propanedinitrile;3-(9,10-dinaphthalen-2-ylanthracen-2-yl)fluoranthene;2,9,10-trinaphthalen-2-ylanthracene?
The IUPAC name of N-[4-(4-carbazol-9-ylphenyl)phenyl]-9,9-diphenyl-N-(4-phenylphenyl)fluoren-2-amine;2-[10-(dicyanomethylidene)-2,8-bis(trifluoromethoxy)indeno[2,1-b]fluoren-12-ylidene]propanedinitrile;3-(9,10-dinaphthalen-2-ylanthracen-2-yl)fluoranthene;2,9,10-trinaphthalen-2-ylanthracene (CID 157179774) is N-[4-(4-carbazol-9-ylphenyl)phenyl]-9,9-diphenyl-N-(4-phenylphenyl)fluoren-2-amine;2-[10-(dicyanomethylidene)-2,8-bis(trifluoromethoxy)indeno[2,1-b]fluoren-12-ylidene]propanedinitrile;3-(9,10-dinaphthalen-2-ylanthracen-2-yl)fluoranthene;2,9,10-trinaphthalen-2-ylanthracene.
What is the SMILES notation for N-[4-(4-carbazol-9-ylphenyl)phenyl]-9,9-diphenyl-N-(4-phenylphenyl)fluoren-2-amine;2-[10-(dicyanomethylidene)-2,8-bis(trifluoromethoxy)indeno[2,1-b]fluoren-12-ylidene]propanedinitrile;3-(9,10-dinaphthalen-2-ylanthracen-2-yl)fluoranthene;2,9,10-trinaphthalen-2-ylanthracene?
The canonical SMILES for N-[4-(4-carbazol-9-ylphenyl)phenyl]-9,9-diphenyl-N-(4-phenylphenyl)fluoren-2-amine;2-[10-(dicyanomethylidene)-2,8-bis(trifluoromethoxy)indeno[2,1-b]fluoren-12-ylidene]propanedinitrile;3-(9,10-dinaphthalen-2-ylanthracen-2-yl)fluoranthene;2,9,10-trinaphthalen-2-ylanthracene is N#CC(C#N)=C1c2cc(OC(F)(F)F)ccc2-c2cc3c(cc21)C(=C(C#N)C#N)c1cc(OC(F)(F)F)ccc1-3.c1ccc(-c2ccc(N(c3ccc(-c4ccc(-n5c6ccccc6c6ccccc65)cc4)cc3)c3ccc4c(c3)C(c3ccccc3)(c3ccccc3)c3ccccc3-4)cc2)cc1.c1ccc2c(c1)-c1cccc3c(-c4ccc5c(-c6ccc7ccccc7c6)c6ccccc6c(-c6ccc7ccccc7c6)c5c4)ccc-2c13.c1ccc2cc(-c3ccc4c(-c5ccc6ccccc6c5)c5ccccc5c(-c5ccc6ccccc6c5)c4c3)ccc2c1.
What is the InChIKey of N-[4-(4-carbazol-9-ylphenyl)phenyl]-9,9-diphenyl-N-(4-phenylphenyl)fluoren-2-amine;2-[10-(dicyanomethylidene)-2,8-bis(trifluoromethoxy)indeno[2,1-b]fluoren-12-ylidene]propanedinitrile;3-(9,10-dinaphthalen-2-ylanthracen-2-yl)fluoranthene;2,9,10-trinaphthalen-2-ylanthracene?
The InChIKey is AOKYIZAGZIDZTO-UHFFFAOYSA-N. The full InChI is InChI=1S/C61H42N2.C50H30.C44H28.C28H8F6N4O2/c1-4-16-43(17-5-1)44-28-34-49(35-29-44)62(50-36-30-45(31-37-50)46-32-38-51(39-33-46)63-59-26-14-11-23-55(59)56-24-12-15-27-60(56)63)52-40-41-54-53-22-10-13-25-57(53)61(58(54)42-52,47-18-6-2-7-19-47)48-20-8-3-9-21-48;1-3-12-33-28-36(22-20-31(33)10-1)48-43-16-7-8-17-44(43)49(37-23-21-32-11-2-4-13-34(32)29-37)47-30-35(24-25-46(47)48)38-26-27-45-40-15-6-5-14-39(40)42-19-9-18-41(38)50(42)45;1-4-12-32-25-35(20-17-29(32)9-1)36-23-24-41-42(28-36)44(38-22-19-31-11-3-6-14-34(31)27-38)40-16-8-7-15-39(40)43(41)37-21-18-30-10-2-5-13-33(30)26-37;29-27(30,31)39-15-1-3-17-19-7-20-18-4-2-16(40-28(32,33)34)6-22(18)26(14(11-37)12-38)24(20)8-23(19)25(21(17)5-15)13(9-35)10-36/h1-42H;1-30H;1-28H;1-8H.
What are the key properties of N-[4-(4-carbazol-9-ylphenyl)phenyl]-9,9-diphenyl-N-(4-phenylphenyl)fluoren-2-amine;2-[10-(dicyanomethylidene)-2,8-bis(trifluoromethoxy)indeno[2,1-b]fluoren-12-ylidene]propanedinitrile;3-(9,10-dinaphthalen-2-ylanthracen-2-yl)fluoranthene;2,9,10-trinaphthalen-2-ylanthracene?
N-[4-(4-carbazol-9-ylphenyl)phenyl]-9,9-diphenyl-N-(4-phenylphenyl)fluoren-2-amine;2-[10-(dicyanomethylidene)-2,8-bis(trifluoromethoxy)indeno[2,1-b]fluoren-12-ylidene]propanedinitrile;3-(9,10-dinaphthalen-2-ylanthracen-2-yl)fluoranthene;2,9,10-trinaphthalen-2-ylanthracene has a molecular weight of 2536.90 g/mol, XLogP of 49.65, 16 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(4-carbazol-9-ylphenyl)phenyl]-9,9-diphenyl-N-(4-phenylphenyl)fluoren-2-amine;2-[10-(dicyanomethylidene)-2,8-bis(trifluoromethoxy)indeno[2,1-b]fluoren-12-ylidene]propanedinitrile;3-(9,10-dinaphthalen-2-ylanthracen-2-yl)fluoranthene;2,9,10-trinaphthalen-2-ylanthracene is sourced from PubChem (CID 157179774), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).